bis(ethylidene(dimethyl)azanium) difluoride

C8H20F2N2 — CID 141287550

IUPACbis(ethylidene(dimethyl)azanium) difluoride
SMILESCC=[N+](C)C.CC=[N+](C)C.[F-].[F-]
InChIInChI=1S/2C4H10N.2FH/c2*1-4-5(2)3;;/h2*4H,1-3H3;2*1H/q2*+1;;/p-2
InChIKeyPUXFTGDGFZDTEH-UHFFFAOYSA-L
MW182.26 g/mol
LogP-5.29
Rot. Bonds

About bis(ethylidene(dimethyl)azanium) difluoride

bis(ethylidene(dimethyl)azanium) difluoride (PubChem CID 141287550) has the molecular formula C8H20F2N2 and a molecular weight of 182.26 g/mol. Its IUPAC name is bis(ethylidene(dimethyl)azanium) difluoride.

Molecular Properties

Compound Namebis(ethylidene(dimethyl)azanium) difluoride
PubChem CID141287550
Molecular FormulaC8H20F2N2
Molecular Weight182.26 g/mol
Exact Mass182.16
IUPAC Namebis(ethylidene(dimethyl)azanium) difluoride
SMILESCC=[N+](C)C.CC=[N+](C)C.[F-].[F-]
InChIInChI=1S/2C4H10N.2FH/c2*1-4-5(2)3;;/h2*4H,1-3H3;2*1H/q2*+1;;/p-2
InChIKeyPUXFTGDGFZDTEH-UHFFFAOYSA-L
XLogP-5.29
TPSA6.02 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.26
LogP ≤ 5-5.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Related Compounds

N-hydroxyethanimine oxide
CID 6852034
(4E)-hexa-2,4-diene
CID 22435466
ethylidene-methyl-prop-2-enylazanium
CID 123140192
ethane;(2Z,4Z)-hexa-2,4-diene
CID 90738434
(4Z,6Z)-octa-1,2,4,6-tetraen-1-amine
CID 134313665
dimethyl(propylidene)azanium;propane
CID 174533960
dimethylaminomethylidene(dimethyl)azanium;hydrofluoride
CID 172692317
(1E,3Z,5Z)-hepta-1,3,5-trien-1-amine
CID 89016465
ethylidene-methyl-(4-methylpent-1-enyl)azanium
CID 123393465
2,3-dimethylbutylidene(dimethyl)azanium
CID 123947542
potassium;hexa-2,4-diene;hydride
CID 174550949
ethane;(2E,4E)-hexa-2,4-diene;methane
CID 158840688

Frequently Asked Questions

What is the IUPAC name of bis(ethylidene(dimethyl)azanium) difluoride?
The IUPAC name of bis(ethylidene(dimethyl)azanium) difluoride (CID 141287550) is bis(ethylidene(dimethyl)azanium) difluoride.
What is the SMILES notation for bis(ethylidene(dimethyl)azanium) difluoride?
The canonical SMILES for bis(ethylidene(dimethyl)azanium) difluoride is CC=[N+](C)C.CC=[N+](C)C.[F-].[F-].
What is the InChIKey of bis(ethylidene(dimethyl)azanium) difluoride?
The InChIKey is PUXFTGDGFZDTEH-UHFFFAOYSA-L. The full InChI is InChI=1S/2C4H10N.2FH/c2*1-4-5(2)3;;/h2*4H,1-3H3;2*1H/q2*+1;;/p-2.
What are the key properties of bis(ethylidene(dimethyl)azanium) difluoride?
bis(ethylidene(dimethyl)azanium) difluoride has a molecular weight of 182.26 g/mol, XLogP of -5.29, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(ethylidene(dimethyl)azanium) difluoride is sourced from PubChem (CID 141287550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).